AC1L4K5K

[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl] (3R)-3-hydroxy-2-methylidene-4-phenylmethoxybutanoate

Also Known As: beta-D-Glucopyranose, 2,3,4,6-tetraacetate 1-(3-hydroxy-2-methylene-4-(phenylmethoxy)butanoate), (R)-|2,3,4,6-Tetra-O-acetyl-1-O-[4-(benzyloxy)-3-hydroxy-2-methylidenebutanoyl]hexopyranose|[(2S,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl] (3R)-3-hydroxy-2-methylidene-4-phenylmethoxybutanoate|2,3,4,6-tetra-O-acetyl-1-O-[(3R)-4-(benzyloxy)-3-hydroxy-2-methylidenebutanoyl]-beta-D-glucopyranose

Molecular Formula	C26H32O13
Molecular Weight	552.18427 g/mol
LogP	1.7
Topological Polar Surface Area	170.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	13
Rotatable Bonds	17
Exact Mass	552.18427
Monoisotopic Mass	552.18427
Heavy Atoms	39
Complexity	894.0

Chemical Identifiers

CAS Number	76299-68-8
SMILES	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(=O)C(=C)[C@H](COCC2=CC=CC=C2)O)OC(=O)C)OC(=O)C)OC(=O)C
InChIKey	AQNAXRYSOBWBDK-NUIZIRNGSA-N